SCHEMBL6674699

SCHEMBL6674699

C=CCOc1c(-c2ccccc2)cccc1C(C)CC1=C(C)C(C)C(C)=C1C

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
MAPT P10636 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PTPRC P08575 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5086945 0.73 ADRB2 (0.32) ADRB2ADRB1MAPT
SCHEMBL5611931 0.66 ADRB2 (0.47) ADRB2ADRB1MAPTMAPK1TDP1
SCHEMBL4624647 0.65 HPGD (0.46) ADRB2ADRB1MAPTMAPK1TDP1
SCHEMBL5085747 0.65 ALDH1A1 (0.46) ADRB2ADRB1MAPTMAPK1TDP1
SCHEMBL6675079 0.63 ADRB2 (0.36) ADRB2ADRB1MAPTPTPRC
SCHEMBL9428743 0.63 ADRB2 (0.40) ADRB2ADRB1LMNAMAPK1TDP1
SCHEMBL5090452 0.62 ATM (0.37) ADRB2ADRB1MAPTPTPRC
SCHEMBL5087116 0.62 MGAM (0.34) MAPT
SCHEMBL515196 0.62 ADRB2 (0.59) ADRB2ADRB1LMNAMAPK1TDP1
SCHEMBL5598909 0.62 TSHR (0.42) ADRB2ADRB1LMNAL3MBTL1PTPRC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0963990-B1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed